0 B14R2.450 CC(=O)C1=C(N)C2=CC=CC=C2O1 ALBB-010676 [1,0,0,0,0,0|3,0,0]=4 1 B14R2.450 CC1=C(C(=O)Cl)OC2=C1C=CC=C2 ALBB-010809 [1,0,0,0,0,0|2,0,1]=4 2 B14R2.450 CC1=C(C(=O)O)OC2=C1C=CC=C2 ALBB-000192 [1,0,0,0,0,0|1,0,1]=3 3 B14R2.450 CN1C(C(=O)O)=CC2=C1C=CC=C2 ALBB-007751 [1,0,0,0,0,0|2,0,1]=4 4 B14R2.450 NC1=C(C(=O)O)SC2=NC=CC=C21 ALBB-004830 [1,0,0,0,0,0|3,0,0]=4 5 B14R2.450 O=C(Cl)C1=C(Cl)C2=C(C=CC=C2)S1 ALBB-010796 [1,0,0,0,0,0|3,0,0]=4 6 B14R2.450 O=C(O)C1=C(Cl)C2=C(C=CC=C2)S1 ALBB-000118 [1,0,0,0,0,0|2,0,0]=3 7 B16R2.6152 COC(=O)C1=C(C=O)C2=CC=CC=C2N1 ALBB-014482 [0,1,0,0,0,0|0,0,0]=1 8 B16R2.11036 CC1=CC=C2NC(C(=O)O)=C(C=O)C2=C1 ALBB-005112 [0,1,0,0,0,0|0,0,0]=1 9 B16R2.48851 CN1C2=CC=CC=C2C(C=O)=C1C(=O)O ALBB-030797 [0,1,0,0,0,0|0,0,0]=1 10 B14R1.980 O=CNC(CC1=CC=CC=C1)C(=O)O ALBB-025056 [0,0,1,0,0,0|2,0,1]=4 11 B16R3.3329 CC1=NC=CC2=C1NC3=C2C=CC=C3 ALBB-009251 [0,0,0,1,0,0|3,0,0]=4 12 B16R3.3329 O=C1CCCC2=C1NC3=CC=CC=C32 ALBB-028915 [0,0,0,1,0,0|2,0,1]=4 13 B16R2.1612 COC1=CC2=CC=CC=C2C=C1C(=O)O ALBB-025075 [0,0,0,0,0,1|3,0,0]=4 14 B16R2.6148 COC1=C(C(=O)O)C=CC2=CC=CC=C21 ALBB-025454 [0,0,0,0,0,1|3,0,0]=4 15 B13R2.45 O=CC1=C(Cl)C2=CC=CC=C2S1 ALBB-025147 [2,0,0,0,0,0|2,0,0]=4 16 B13R2.435 CC(=O)C1=NC2=CC=CC=C2N1 ALBB-020352 [2,0,0,0,0,0|2,0,0]=4 17 B13R2.435 NC(=O)C1=NC2=CC=CC=C2N1 ALBB-035730 [2,0,0,0,0,0|2,0,0]=4 18 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)O1 ALBB-016356 [2,0,0,0,0,0|1,0,0]=3 19 B13R2.435 O=C(O)C1=CC2=CC=CC=C2S1 ALBB-032943 [2,0,0,0,0,0|1,0,0]=3 20 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 ALBB-014746 [2,0,0,0,0,0|1,0,1]=4 21 B13R2.435 O=C(O)C1=NC2=CC=CC=C2N1 ALBB-010231 [2,0,0,0,0,0|1,0,0]=3 22 B13R2.435 O=C(O)C1=NC2=CC=CC=C2N1 ALBB-010231 [2,0,0,0,0,0|1,0,0]=3 23 B13R2.135 CC1=C(C=O)C2=C(C=CC=C2)N1 ALBB-000205 [2,0,0,0,0,0|0,0,1]=3 24 B13R2.135 N\N=C1/C(=O)NC2=CC=CC=C21 ALBB-032084 [2,0,0,0,0,0|2,0,0]=4 25 B13R2.135 O=C1NC2=C(C=CC=C2)\C1=N/O ALBB-006595 [2,0,0,0,0,0|1,0,1]=4 26 B13R2.135 O=CC1C(=O)NC2=CC=CC=C21 ALBB-011784 [2,0,0,0,0,0|0,0,1]=3 27 B15R2.1592 CNC(=O)C1=C(C)C2=CC=CC=C2N1 ALBB-014472 [1,1,0,0,0,0|1,0,1]=4 28 B15R2.1592 COC(=O)C1=C(N)C2=C(C=CC=C2)S1 ALBB-028264 [1,1,0,0,0,0|2,0,0]=4 29 B15R2.7203 CC1=C(C(=O)O)NC2=CC=C(F)C=C21 ALBB-005029 [1,1,0,0,0,0|0,0,1]=3 30 B15R2.7203 CC1=CC2=C(C=C1)NC(C(=O)O)=C2C ALBB-007749 [1,1,0,0,0,0|0,0,1]=3 31 B15R2.9921 CC1=C(C(=O)O)N(C)C2=CC=CC=C21 ALBB-005033 [1,1,0,0,0,0|0,0,1]=3 32 B15R2.13463 CC1=C(C(=O)O)NC2=C(F)C=CC=C12 ALBB-031493 [1,1,0,0,0,0|0,0,1]=3 33 B15R2.13463 CC1=C2NC(C(N)=O)=C(C)C2=CC=C1 ALBB-027990 [1,1,0,0,0,0|1,0,1]=4 34 B15R2.13629 O=C(O)C1=C(Cl)C2=C(C=CC=C2Cl)S1 ALBB-000958 [1,1,0,0,0,0|2,0,0]=4 35 B15R2.13629 O=C(O)C1=C(Cl)C2=C(C=CC=C2F)S1 ALBB-000941 [1,1,0,0,0,0|2,0,0]=4 36 B15R2.14758 CC1=CC2=C(C=C1)C(Cl)=C(C(=O)O)S2 ALBB-000953 [1,1,0,0,0,0|2,0,0]=4 37 B15R2.14758 O=C(O)C1=C(Cl)C2=C(C=C(Br)C=C2)S1 ALBB-000955 [1,1,0,0,0,0|2,0,0]=4 38 B15R2.14758 O=C(O)C1=C(Cl)C2=C(C=C(Cl)C=C2)S1 ALBB-000952 [1,1,0,0,0,0|2,0,0]=4 39 B15R2.14758 O=C(O)C1=C(Cl)C2=C(C=C(F)C=C2)S1 ALBB-000951 [1,1,0,0,0,0|2,0,0]=4 40 B15R2.1759 CCC1=C(C=O)NC2=CC=C(C)C=C21 ALBB-007592 [1,1,0,0,0,0|1,0,1]=4 41 B17R2.45129 OC(=O)C1=CC(C(=O)O)=NC2=CC=CC=C21 ALBB-035147 [0,1,0,0,0,1|0,0,1]=3 42 B17R2.45503 O=C(O)CN1C(C(=O)O)=CC2=CC=CC=C21 ALBB-034485 [0,2,0,0,0,0|2,0,0]=4 43 B17R2.139295 C(=O)C1=C(C(=O)OC)NC2=CC=C(Br)C=C21 ALBB-035489 [0,2,0,0,0,0|0,0,0]=2 44 B17R2.139295 C(=O)C1=C(C(=O)OC)NC2=CC=C(Cl)C=C21 ALBB-035478 [0,2,0,0,0,0|0,0,0]=2 45 B17R2.139295 C(=O)C1=C(C(=O)OC)NC2=CC=C(F)C=C21 ALBB-035492 [0,2,0,0,0,0|0,0,0]=2 46 B17R2.139318 C(=O)C1=C(C(=O)O)N(C)C2=CC=C(Br)C=C21 ALBB-035472 [0,2,0,0,0,0|0,0,0]=2 47 B15R2.993 O=C(O)CN1C(=O)OC2=C1C=CC=C2 ALBB-012639 [0,0,1,1,0,0|1,0,1]=4 48 B15R2.14951 O=C(O)C1=NC2=CC=CC=C2C(O)=C1 ALBB-014130 [0,0,1,1,0,0|0,0,2]=4 49 B15R2.1255 O=C(O)C(=O)C1=CNC2=C1C=CC=C2 ALBB-014238 [0,0,1,1,0,0|2,0,0]=4 50 B17R3.34323 O=C1NC(=O)C2=C(N1)NC3=CC=CC=C32 ALBB-013933 [0,0,0,1,0,1|1,0,0]=3 51 B15R2.627 O=C(O)C1=CNC2=CC=CC=C2C1=O ALBB-030902 [1,0,0,0,0,1|0,0,0]=2 52 B15R2.627 O=C1C2=CC=CC=C2NC=C1[N+](=O)[O-] ALBB-013499 [1,0,0,0,0,1|1,0,1]=4 53 B15R2.629 O=C(O)CN1CC2=C(C=CC=C2)C1=O ALBB-015647 [1,0,0,0,0,1|2,0,0]=4 54 B15R2.629 O=C(O)CN1NC2=CC=CC=C2C1=O ALBB-016236 [1,0,0,0,0,1|1,0,0]=3